TL;DR: C22H24ClN3O5S (CAS 1173662-80-0) is a chemical compound with molecular formula C22H24ClN3O5S and molecular weight 477.11252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(1S)-1-[5-[(3-chlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-phenylethyl]carbamate
Also Known As: (S)-tert-butyl (1-(5-((3-chlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-phenylethyl)carbamate, tert-butyl [(1S)-1-{5-[(3-chlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-phenylethyl]carbamate, tert-butyl N-[(1S)-1-[5-[(3-chlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-phenylethyl]carbamate
| Molecular Formula | C22H24ClN3O5S |
| Molecular Weight | 477.11252 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 477.11252 Da |
| Heavy Atoms | 32 |
| Complexity | 718.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C2=NN=C(O2)S(=O)(=O)CC3=CC(=CC=C3)Cl |
| InChIKey | XXALXZGKEPJJNK-SFHVURJKSA-N |
The XLogP value of 4.0 indicates that C22H24ClN3O5S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H24ClN3O5S. Following Lipinski's Rule of Five, C22H24ClN3O5S has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C22H24ClN3O5S is 1173662-80-0.
The molecular formula of C22H24ClN3O5S is C22H24ClN3O5S.
The molecular weight of C22H24ClN3O5S is 477.11252 g/mol.
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